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Orazio Nicolotti
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CERAPP: collaborative estrogen receptor activity prediction project
K Mansouri, A Abdelaziz, A Rybacka, A Roncaglioni, A Tropsha, A Varnek, ...
Environmental health perspectives 124 (7), 1023-1033, 2016
3082016
Applicability domain for QSAR models: where theory meets reality
D Gadaleta, GF Mangiatordi, M Catto, A Carotti, O Nicolotti
International journal of quantitative structure-property relationships …, 2016
2712016
Activity cliffs in drug discovery: Dr Jekyll or Mr Hyde?
M Cruz-Monteagudo, JL Medina-Franco, Y Pérez-Castillo, O Nicolotti, ...
Drug Discovery Today 19 (8), 1069-1080, 2014
1842014
CoMPARA: collaborative modeling project for androgen receptor activity
K Mansouri, N Kleinstreuer, AM Abdelaziz, D Alberga, VM Alves, ...
Environmental Health Perspectives 128 (2), 027002, 2020
1352020
Structural insights into monoamine oxidase inhibitory potency and selectivity of 7-substituted coumarins from ligand-and target-based approaches
M Catto, O Nicolotti, F Leonetti, A Carotti, AD Favia, R Soto-Otero, ...
Journal of medicinal chemistry 49 (16), 4912-4925, 2006
1272006
Discovery of a novel class of potent coumarin monoamine oxidase B inhibitors: development and biopharmacological profiling of 7-[(3-chlorobenzyl) oxy]-4-[(methylamino) methyl …
L Pisani, G Muncipinto, TF Miscioscia, O Nicolotti, F Leonetti, M Catto, ...
Journal of medicinal chemistry 52 (21), 6685-6706, 2009
1212009
Multiobjective optimization in quantitative structure− activity relationships: deriving accurate and interpretable QSARs
O Nicolotti, VJ Gillet, PJ Fleming, DVS Green
Journal of Medicinal Chemistry 45 (23), 5069-5080, 2002
1112002
Design, synthesis and biological evaluation of coumarin alkylamines as potent and selective dual binding site inhibitors of acetylcholinesterase
M Catto, L Pisani, F Leonetti, O Nicolotti, P Pesce, A Stefanachi, ...
Bioorganic & medicinal chemistry 21 (1), 146-152, 2013
1072013
Design, synthesis, and biological evaluation of imidazolyl derivatives of 4, 7-disubstituted coumarins as aromatase inhibitors selective over 17-α-hydroxylase/C17− 20 lyase
A Stefanachi, AD Favia, O Nicolotti, F Leonetti, L Pisani, M Catto, ...
Journal of medicinal chemistry 54 (6), 1613-1625, 2011
1022011
Structure-Based Design and Optimization of Multitarget-Directed 2H-Chromen-2-one Derivatives as Potent Inhibitors of Monoamine Oxidase B and Cholinesterases
R Farina, L Pisani, M Catto, O Nicolotti, D Gadaleta, N Denora, ...
Journal of medicinal chemistry 58 (14), 5561-5578, 2015
972015
Targeting monoamine oxidases with multipotent ligands: an emerging strategy in the search of new drugs against neurodegenerative diseases
L Pisani, M Catto, F Leonetti, O Nicolotti, A Stefanachi, F Campagna, ...
Current medicinal chemistry 18 (30), 4568-4587, 2011
952011
A generalizable definition of chemical similarity for read-across
M Floris, A Manganaro, O Nicolotti, R Medda, GF Mangiatordi, E Benfenati
Journal of cheminformatics 6, 1-7, 2014
922014
Exploring basic tail modifications of coumarin-based dual acetylcholinesterase-monoamine oxidase B inhibitors: identification of water-soluble, brain-permeant neuroprotective …
L Pisani, R Farina, M Catto, RM Iacobazzi, O Nicolotti, S Cellamare, ...
Journal of Medicinal Chemistry 59 (14), 6791-6806, 2016
872016
Quinolizidinyl derivatives of bi-and tricyclic systems as potent inhibitors of acetyl-and butyrylcholinesterase with potential in Alzheimer’s disease
B Tasso, M Catto, O Nicolotti, F Novelli, M Tonelli, I Giangreco, L Pisani, ...
European Journal of Medicinal Chemistry 46 (6), 2170-2184, 2011
872011
Design, synthesis and pharmacobiological evaluation of novel acrylic acid derivatives acting as lipoxygenase and cyclooxygenase-1 inhibitors with antioxidant and anti …
E Pontiki, D Hadjipavlou-Litina, K Litinas, O Nicolotti, A Carotti
European journal of medicinal chemistry 46 (1), 191-200, 2011
852011
REACH and in silico methods: an attractive opportunity for medicinal chemists
O Nicolotti, E Benfenati, A Carotti, D Gadaleta, A Gissi, GF Mangiatordi, ...
Drug Discovery Today 19 (11), 1757-1768, 2014
842014
Inactivation of the glutamine/amino acid transporter ASCT2 by 1, 2, 3-dithiazoles: proteoliposomes as a tool to gain insights in the molecular mechanism of action and of …
F Oppedisano, M Catto, PA Koutentis, O Nicolotti, L Pochini, M Koyioni, ...
Toxicology and applied pharmacology 265 (1), 93-102, 2012
842012
Ligand efficiency metrics in drug discovery: The pros and cons from a practical perspective
MM Cavalluzzi, GF Mangiatordi, O Nicolotti, G Lentini
Expert opinion on drug discovery 12 (11), 1087-1104, 2017
802017
CATMoS: collaborative acute toxicity modeling suite
K Mansouri, AL Karmaus, J Fitzpatrick, G Patlewicz, P Pradeep, D Alberga, ...
Environmental health perspectives 129 (4), 047013, 2021
792021
Design, synthesis, and biological evaluation of coumarin derivatives tethered to an edrophonium‐like fragment as highly potent and selective dual binding site …
L Pisani, M Catto, I Giangreco, F Leonetti, O Nicolotti, A Stefanachi, ...
ChemMedChem 5 (9), 1616-1630, 2010
762010
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